Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 4/20 | 0.46 |
| ▸ | RXRA | P19793 | 1/20 | 0.45 |
| ▸ | XDH | P47989 | 2/20 | 0.45 |
| ▸ | PTGER1 | P34995 | 10/20 | 0.44 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | HTR7 | P34969 | 1/20 | 0.43 |
| ▸ | HTR6 | P50406 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL8703967 | 0.95 | CCR5 (0.48) | CCR5RXRAXDHPTGER1HCAR3 | |
| SCHEMBL1907786 | 0.92 | RXRA (0.53) | CCR5RXRAPTGER1HCAR3CYP1A2 | |
| SCHEMBL8167606 | 0.91 | CCR5 (0.58) | CCR5RXRAXDHPTGER1 | |
| SCHEMBL8162210 | 0.90 | ALDH1A1 (0.45) | CCR5RXRAXDHPTGER1HCAR3 | |
| SCHEMBL8161455 | 0.85 | PTGER1 (0.54) | CCR5RXRAPTGER1 | |
| SCHEMBL7672615 | 0.85 | HCAR3 (0.51) | RXRAHCAR3NPC1LMNAMAPT | |
| SCHEMBL8167295 | 0.85 | PTGER1 (0.46) | CCR5RXRAPTGER1CYP1A2ALDH1A1 | |
| SCHEMBL6256530 | 0.84 | RXRA (0.51) | CCR5RXRAPTGER1HCAR3CYP1A2 | |
| SCHEMBL7662467 | 0.84 | CCR5 (0.45) | CCR5RXRAPTGER1CYP1A2ALDH1A1 | |
| SCHEMBL8167287 | 0.83 | HCAR3 (0.41) | CCR5RXRAPTGER1HCAR3CYP1A2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0773930-A1 | AROMATIC AMINO ETHERS AS PAIN RELIEVING AGENTS | ZENECA LIMITED (GB) | 1997-05-21 | — | — | EP | claimed |
| US-5843942-A | Aromatic amino ethers as pain relieving agents | ZENECA LIMITED (GB) | 1998-12-01 | — | — | US | disclosed |
| WO-1996003380-A1 | AROMATIC AMINO ETHERS AS PAIN RELIEVING AGENTS | ZENECA LIMITED (GB) | 1996-02-08 | — | — | WO | disclosed |